N-[(E)-1-(furan-2-yl)-3-[2-(1H-indol-3-yl)ethylamino]-3-oxoprop-1-en-2-yl]furan-2-carboxamide

Formula:C22H19N3O4 Mutagenic:high Tumorigenic:none Reproductive Effective:none N-[(E)-1-(furan-2-yl)-3-[2-(1H-indol-3-yl)ethylamino]-3-oxoprop-1-en-2-yl]furan-2-carboxamide is a drug-like molecule.

MolNameN-[(E)-1-(furan-2-yl)-3-[2-(1H-indol-3-yl)ethylamino]-3-oxoprop-1-en-2-yl]furan-2-carboxamide
MolecularFormulaC22H19N3O4
SmilesO=C(/C(/NC(c1ccco1)=O)=C\c1ccco1)NCCc1c[nH]c2c1cccc2
InChIInChI=1S/C22H19N3O4/c26-21(23-10-9-15-14-24-18-7-2-1-6-17(15)18)19(13-16-5-3-11-28-16)25-22(27)20-8-4-12-29-20/h1-8,11-14,24H,9-10H2,(H,23,26)(H,25,27)
InChIKCYRKIWNYSPIWRS-UHFFFAOYSA-N
TotalMolweight389.41
Molweight389.41
MonoisotopicMass389.137557
CLogP2.9801
CLogS-4.69
H Acceptors7
H Donors3
TotalSurfaceArea306.98
Relative PSA0.29712
PolarSurfaceArea100.27
Druglikeness3.8067
Mutagenichigh
Tumorigenicnone
Reproductive Effectivenone
Irritantnone
Nasty Functions
Shape Index0.51724
Fragments1
Non HAtoms29
NonCHAtoms7
Electronegative Atoms7
Rotatable Bond7
Rings Closures4
Small Rings4
Aromatic Rings4
Aromatic Atoms19
Sp3Atoms2
Amides2
Aromatic Nitrogens1
StereoCon

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